4-[4-[[4-bromanyl-3-(trifluoromethyl)phenyl]carbamoylamino]phenoxy]-N-methyl-1-oxidanidyl-pyridin-1-ium-2-carboxamide

Systemtic Name: 4-[4-[[4-bromanyl-3-(trifluoromethyl)phenyl]carbamoylamino]phenoxy]-N-methyl-1-oxidanidyl-pyridin-1-ium-2-carboxamide Openeye Name: 4-[4-[[4-bromo-3-(trifluoromethyl)phenyl]carbamoylamino]phenoxy]-N-methyl-1-oxido-pyridin-1-ium-2-carboxamide CAS Name: 4-[4-[[[4-bromo-3-(trifluoromethyl)anilino]-oxomethyl]amino]phenoxy]-N-methyl-1-oxido-2-pyridin-1-iumcarboxamide IUPAC Name: 4-[4-[[4-bromo-3-(trifluoromethyl)phenyl]carbamoylamino]phenoxy]-N-methyl-1-oxidopyridin-1-ium-2-carboxamide Traditional Name: 4-[4-[[4-bromo-3-(trifluoromethyl)phenyl]carbamoylamino]phenoxy]-N-methyl-1-oxido-pyridin-1-ium-2-carboxamide Formula: C21H16BrF3N4O4 MolecularWeight: 525.27535

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1=[N+](C=CC(=C1)OC2=CC=C(C=C2)NC(=O)NC3=CC(=C(C=C3)Br)C(F)(F)F)[O-]

Isomeric SMILES

CNC(=O)C1=[N+](C=CC(=C1)OC2=CC=C(C=C2)NC(=O)NC3=CC(=C(C=C3)Br)C(F)(F)F)[O-]

InChI

InChI=1S/C21H16BrF3N4O4/c1-26-19(30)18-11-15(8-9-29(18)32)33-14-5-2-12(3-6-14)27-20(31)28-13-4-7-17(22)16(10-13)21(23,24)25/h2-11H,1H3,(H,26,30)(H2,27,28,31)